2-(5-chloranyl-4,6-dimethyl-1-benzofuran-3-yl)-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-(5-chloranyl-4,6-dimethyl-1-benzofuran-3-yl)-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-(5-chloro-4,6-dimethyl-benzofuran-3-yl)-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-(5-chloro-4,6-dimethyl-3-benzofuranyl)-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-(5-chloro-4,6-dimethyl-1-benzofuran-3-yl)-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-(5-chloro-4,6-dimethyl-benzofuran-3-yl)-1-(4-phenylpiperazino)ethanone Formula: C22H23ClN2O2 MolecularWeight: 382.88322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1Cl)C)C(=CO2)CC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C(=C1Cl)C)C(=CO2)CC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H23ClN2O2/c1-15-12-19-21(16(2)22(15)23)17(14-27-19)13-20(26)25-10-8-24(9-11-25)18-6-4-3-5-7-18/h3-7,12,14H,8-11,13H2,1-2H3